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[8-L-LYSINE-9-D-ALANINE-NH2]VASOPRESSIN POLYPEPTIDE
SpectraBase Compound ID BHTIEG7kOrP
InChI InChI=1S/C47H69N13O12S2/c1-25(39(52)64)53-41(66)30(10-5-6-18-48)55-46(71)36-11-7-19-60(36)47(72)35(24-74)59-45(70)34(22-38(51)63)58-42(67)31(16-17-37(50)62)54-43(68)33(20-26-8-3-2-4-9-26)57-44(69)32(56-40(65)29(49)23-73)21-27-12-14-28(61)15-13-27/h2-4,8-9,12-15,25,29-36,61,73-74H,5-7,10-11,16-24,48-49H2,1H3,(H2,50,62)(H2,51,63)(H2,52,64)(H,53,66)(H,54,68)(H,55,71)(H,56,65)(H,57,69)(H,58,67)(H,59,70)
InChIKey BEGNCOFVOHJMPG-UHFFFAOYSA-N
Mol Weight 1072.3 g/mol
Molecular Formula C47H69N13O12S2
Exact Mass 1071.463007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BLp2nUnHw7f
Name [8-L-LYSINE-9-D-ALANINE-NH2]VASOPRESSIN POLYPEPTIDE
Comments ,
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Formula C47H69N13O12S2
InChI InChI=1S/C47H69N13O12S2/c1-25(39(52)64)53-41(66)30(10-5-6-18-48)55-46(71)36-11-7-19-60(36)47(72)35(24-74)59-45(70)34(22-38(51)63)58-42(67)31(16-17-37(50)62)54-43(68)33(20-26-8-3-2-4-9-26)57-44(69)32(56-40(65)29(49)23-73)21-27-12-14-28(61)15-13-27/h2-4,8-9,12-15,25,29-36,61,73-74H,5-7,10-11,16-24,48-49H2,1H3,(H2,50,62)(H2,51,63)(H2,52,64)(H,53,66)(H,54,68)(H,55,71)(H,56,65)(H,57,69)(H,58,67)(H,59,70)
InChIKey BEGNCOFVOHJMPG-UHFFFAOYSA-N
Instrument Name Bruker AM-400
Literature Reference Z.PROCHAZKA, J.E.ANCANS, J.SLANINOVA, A.MACHOVA, T.BARTH, J.SKOPKOVA,M.BUDESINSKY, F.PAVLIKOVA, M.LEBL (1988) Coll.Czech.Chem.Comm.: v.53, N11, 2604-2616.
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo